Cas no 887567-75-1 (3-BROMO-4-CHLORO-6-METHYL-(1H)INDAZOLE)
887567-75-1 structure
Product Name:3-BROMO-4-CHLORO-6-METHYL-(1H)INDAZOLE
CAS No:887567-75-1
MF:C8H6BrClN2
MW:245.503639698029
CID:3031279
PubChem ID:24728421
Update Time:2025-04-21
3-BROMO-4-CHLORO-6-METHYL-(1H)INDAZOLE Chemical and Physical Properties
Names and Identifiers
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- 3-BROMO-4-CHLORO-6-METHYL-(1H)INDAZOLE
- 3-Bromo-4-chloro-6-methyl-1H-indazole
- 887567-75-1
- 3-bromo-4-chloro-6-methyl-2H-indazole
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- Inchi： 1S/C8H6BrClN2/c1-4-2-5(10)7-6(3-4)11-12-8(7)9/h2-3H,1H3,(H,11,12)
- InChI Key： PAROSALUHWEPOC-UHFFFAOYSA-N
- SMILES： BrC1=C2C(=CC(C)=CC2=NN1)Cl
Computed Properties
- Exact Mass: 243.94029Da
- Monoisotopic Mass: 243.94029Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 178
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.6
- Topological Polar Surface Area: 28.7?2
3-BROMO-4-CHLORO-6-METHYL-(1H)INDAZOLE Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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